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CS-W001157 4
Total: USD 88.00

2-(2-Methylpropyl)-1h-1,3-benzodiazole

  • CAS No. 5851-45-6

  • Cat. No. CS-0246679
  • Molecule weight174.24
  • Purity≥97%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

2-(2-Methylpropyl)-1h-1,3-benzodiazole|CS-0246679

Structure of 5851-45-6

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General Information

  • CAS No. 5851-45-6
  • Cat. No. CS-0246679
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₄N₂
  • Molecular Weight 174.24
  • Synonym(s) 2-Isobutyl-1H-benzimidazole
  • SMILES CC(C)CC1=NC2=CC=CC=C2N1

Synthesis

  • Route1
    • Triisopentylamine|CS-0454516
      645-41-0
    • null|null
      95-54-5
    • ~70%
    • 2-(2-Methylpropyl)-1h-1,3-benzodiazole|CS-0246679
      5851-45-6

    References

    • Tran, Ngoc Thang; Cho, Chan Sik Bulletin of the Korean Chemical Society, 2012 , vol. 33, # 12 p. 4188 - 4190
  • Route2

    References

    • Cai, Lijian; Ji, Xiaofeng; Yao, Zhigang; Xu, Fan; Shen, Qi Chinese Journal of Chemistry, 2011 , vol. 29, # 9 p. 1880 - 1886
  • Route3
    • null|null
      123-51-3
    • null|null
      95-54-5
    • ~54%
    • 2-(2-Methylpropyl)-1h-1,3-benzodiazole|CS-0246679
      5851-45-6

    References

    • Ramachandran, Rangasamy; Prakash, Govindan; Selvamurugan, Sellappan; Viswanathamurthi, Periasamy; Malecki, Jan Grzegorz; Ramkumar, Venkatachalam Dalton Transactions, 2014 , vol. 43, # 21 p. 7889 - 7902

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H320
Precautionary Statements : P264-P280-P302+P352-P305+P351+P338-P362

Quality Control

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Computational Chemistry Data

  • TPSA   28.68
  • LogP   2.7614
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   2

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